3-[2-[(2R)-1-[(2-methoxy-5-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl]oxy-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazin-1-olate

Systemtic Name: 3-[2-[(2R)-1-[(2-methoxy-5-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl]oxy-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazin-1-olate Openeye Name: 3-[2-[(1R)-2-(2-methoxy-5-nitro-anilino)-1-methyl-2-oxo-ethoxy]-2-oxo-ethyl]-4-oxo-phthalazin-1-olate CAS Name: 3-[2-[(2R)-1-(2-methoxy-5-nitroanilino)-1-oxopropan-2-yl]oxy-2-oxoethyl]-4-oxo-1-phthalazinolate IUPAC Name: 3-[2-[(2R)-1-(2-methoxy-5-nitroanilino)-1-oxopropan-2-yl]oxy-2-oxoethyl]-4-oxophthalazin-1-olate Traditional Name: 4-keto-3-[2-keto-2-[(1R)-2-keto-2-(2-methoxy-5-nitro-anilino)-1-methyl-ethoxy]ethyl]phthalazin-1-olate Formula: C20H17N4O8- MolecularWeight: 441.37098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)OC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)[O-]

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)OC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)[O-]

InChI

InChI=1S/C20H18N4O8/c1-11(18(26)21-15-9-12(24(29)30)7-8-16(15)31-2)32-17(25)10-23-20(28)14-6-4-3-5-13(14)19(27)22-23/h3-9,11H,10H2,1-2H3,(H,21,26)(H,22,27)/p-1/t11-/m1/s1